4-Acetylamino-2-(diallylamino)anisole

Base Information

• Chemical Name: 4-Acetylamino-2-(diallylamino)anisole
• CAS No.: 51868-45-2
• Molecular Formula: C15H20N2O2
• Molecular Weight: 260.336
• Hs Code.: 2924299090
• European Community (EC) Number: 610-746-4
• DSSTox Substance ID: DTXSID80402740
• Nikkaji Number: J29.421G
• Wikidata: Q72434586
• Mol file: 51868-45-2.mol

Synonyms:51868-45-2;4-Acetylamino-2-(diallylamino)anisole;N-[3-[bis(prop-2-enyl)amino]-4-methoxyphenyl]acetamide;N-(3-(Diallylamino)-4-methoxyphenyl)acetamide;3-(N,N-Diallyl)amino-4-methoxyacetanilide;SCHEMBL9327923;DTXSID80402740;3'-Diallylamino-4'-methoxyacetanilide;AKOS015890511;3-(N,N-Diallyl) Amino-4-Methoxyacetanilide;3-(N,N-Diallyl)amino-4-methoxy acetanilide;4-Acetylamino-2-(diallylamino)anisole, 97%;FT-0613823;3-(DIALLYLAMINO)-4-METHOXYACETANILIDE;A828820;N-[3-[bis(prop-2-enyl)amino]-4-methoxy-phenyl]ethanamide

Chemical Property of 4-Acetylamino-2-(diallylamino)anisole

Chemical Property:

• Vapor Pressure: 3.83E-07mmHg at 25°C
• Melting Point: 75-78 °C(lit.)
• Refractive Index: 1.574
• Boiling Point: 416.394 °C at 760 mmHg
• PKA: 14.19±0.70(Predicted)
• Flash Point: 205.628 °C
• PSA: 41.57000
• Density: 1.081 g/cm³
• LogP: 2.90500
• XLogP3: 2.6
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 7
• Exact Mass: 260.152477885
• Heavy Atom Count: 19
• Complexity: 307

Purity/Quality:

99% ^*data from raw suppliers

N-[3-(Di-2-propen-1-ylamino)-4-methoxyphenyl]-acetamide ^*data from reagent suppliers

Safty Information:

• Safety Statements: 22-24/25

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(=O)NC1=CC(=C(C=C1)OC)N(CC=C)CC=C
• Uses: N-[3-(Di-2-propen-1-ylamino)-4-methoxyphenyl]-acetamide is a useful organic building block.

Technology Process of 4-Acetylamino-2-(diallylamino)anisole

There total 5 articles about 4-Acetylamino-2-(diallylamino)anisole which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 98.1%

3-amino-4-methoxyacetanilide (6375-47-9) + 3-chloroprop-1-ene (107-05-1) → 3-(N,N-diprop-2-enamino)-4-methoxyacetanilide (51868-45-2)

Guidance literature:

3-amino-4-methoxyacetanilide; With sodium carbonate; In water; for 0.25h;

3-chloroprop-1-ene; In water; at 82 - 92 ℃; for 4h;

Reference yield: 98.0%

3-amino-4-methoxyacetanilide (6375-47-9) + propenyl chloride (590-21-6) → 3-(N,N-diprop-2-enamino)-4-methoxyacetanilide (51868-45-2)

Guidance literature:

With ammonium hydroxide; In water; at 80 - 85 ℃; for 6h; pH=5 - 6; Large scale;

Reference yield: 93.5%

allyl iodid (556-56-9) + 3-amino-4-methoxyacetanilide (6375-47-9) → 3-(N,N-diprop-2-enamino)-4-methoxyacetanilide (51868-45-2)

Guidance literature:

With potassium carbonate; In acetone; for 0.5h; Heating;

upstream raw materials:

allyl iodid

3-amino-4-methoxyacetanilide

allyl bromide

propenyl chloride

Downstream raw materials:

2-[(2-bromo-4,6-dinitrophenyl)azo]-5-(diallylamino)-4-methoxyacetanilide

C₂₁H₂₁ClN₆O₆

Refernces

• 1、 -. "A supercritical CO2For vinylsulfonyl reactive disperse dyes and its preparation method and application (by machine translation)". Paragraph 0042; 0045. . Retrieved 2017/08/28.
• 2、 Watanabe, Tetsushi,Shiozawa, Tatsushi,Takahashi, Yoshifumi,Takahashi, Tomoyuki,Terao, Yoshiyasu,Nukaya, Haruo,Takamura, Takeji,Sawanishi, Hiroyuki,Ohe, Takeshi,Hirayama, Teruhisa,Wakabayashi, Keiji. "Mutagenicity of two 2-phenylbenzotriazole derivatives, 2-[2-(acetylamino)-4-(diethylamino)-5-methoxyphenyl]-5-amino- 7-bromo-4-chloro-2H-benzotriazole and 2-[2-(acetylamino)-4-(diallylamino)-5-methoxyphenyl]-5-amino-7-bromo-4-chloro-2H-benzotriazole and their detection in river water in Japan.". . p. 293 - 299. Retrieved 2008/04/18.